HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4607",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4605",
"results": [
{
"id": "jvasp-41237",
"created_at": "2022-09-04T14:37:53.436219Z",
"updated_at": "2022-09-04T14:37:53.436239Z",
"structure_string": "Ac1 Mg5\n1.0\n3.078912 -5.332831 -0.000000\n3.078912 5.332831 0.000000\n-0.000000 -0.000000 4.970926\nAc Mg\n1 5\ndirect\n-0.000000 0.000000 0.500000 Ac\n0.499817 0.499817 0.000000 Mg\n0.666667 0.333333 0.500000 Mg\n0.500182 -0.000000 0.000000 Mg\n0.333333 0.666667 0.500000 Mg\n-0.000000 0.500182 -0.000000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ac",
"Mg"
],
"chemical_system": "Ac-Mg",
"density": 3.5453624647897,
"density_atomic": 0.03675605218947701,
"volume": 163.23842313287815,
"volume_molar": 16.384079359110544,
"formula_full": "Ac1 Mg5",
"formula_reduced": "AcMg5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 191
},
{
"id": "jvasp-39651",
"created_at": "2022-09-04T14:37:41.719519Z",
"updated_at": "2022-09-04T14:37:41.719529Z",
"structure_string": "Yb2 Cd1 Pb1\n1.0\n0.000000 3.787645 3.787645\n3.787645 0.000000 3.787645\n3.787645 3.787645 0.000000\nYb Cd Pb\n2 1 1\ndirect\n0.500002 0.500002 0.500002 Yb\n0.000000 0.000000 0.000000 Yb\n0.250000 0.250000 0.250000 Cd\n0.750000 0.750000 0.750000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Cd",
"Pb"
],
"chemical_system": "Cd-Pb-Yb",
"density": 10.171476130738647,
"density_atomic": 0.03680630263437925,
"volume": 108.6770393574867,
"volume_molar": 16.36171070977112,
"formula_full": "Yb2 Cd1 Pb1",
"formula_reduced": "Yb2CdPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-39770",
"created_at": "2022-09-04T14:37:41.748410Z",
"updated_at": "2022-09-04T14:37:41.748432Z",
"structure_string": "Yb6 Ge2 O2\n1.0\n6.531253 -0.000002 -0.000001\n-0.000002 6.501819 -0.069365\n-3.265625 -3.220387 4.634603\nYb Ge O\n6 2 2\ndirect\n0.289161 0.741621 0.500007 Yb\n0.710845 0.241620 0.500007 Yb\n0.780695 0.250643 0.039669 Yb\n0.241096 0.232770 0.960354 Yb\n0.219256 0.732771 0.960354 Yb\n0.758972 0.750642 0.039669 Yb\n0.249370 0.241651 0.499972 Ge\n0.750601 0.741652 0.499973 Ge\n0.499995 0.991673 0.000005 O\n0.000010 0.491672 0.000003 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Yb",
"Ge",
"O"
],
"chemical_system": "Ge-O-Yb",
"density": 10.33233252716008,
"density_atomic": 0.051190290828235126,
"volume": 195.3495445758296,
"volume_molar": 11.764224548375404,
"formula_full": "Yb6 Ge2 O2",
"formula_reduced": "Yb3GeO",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 15
},
{
"id": "jvasp-59031",
"created_at": "2022-09-04T14:37:55.212770Z",
"updated_at": "2022-09-04T14:37:55.212784Z",
"structure_string": "K8 Mn2 Br12\n1.0\n8.883085 0.029062 0.029152\n0.029150 8.883085 0.029152\n0.029062 0.029062 8.883086\nK Mn Br\n8 2 12\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.629463 0.870538 0.250000 K\n0.250000 0.629463 0.870537 K\n0.870538 0.250000 0.629463 K\n0.370537 0.129463 0.750000 K\n0.750000 0.370537 0.129463 K\n0.129463 0.750000 0.370537 K\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.442787 0.792637 0.568351 Br\n0.057213 0.931649 0.707363 Br\n0.931649 0.707363 0.057213 Br\n0.707363 0.057213 0.931649 Br\n0.207363 0.431649 0.557214 Br\n0.292637 0.942787 0.068351 Br\n0.557214 0.207363 0.431649 Br\n0.942787 0.068351 0.292637 Br\n0.068351 0.292637 0.942787 Br\n0.568351 0.442786 0.792637 Br\n0.431649 0.557214 0.207363 Br\n0.792637 0.568351 0.442786 Br\n",
"nsites": 22,
"nelements": 3,
"elements": [
"K",
"Mn",
"Br"
],
"chemical_system": "Br-K-Mn",
"density": 3.272847277005588,
"density_atomic": 0.03138666242688279,
"volume": 700.9346741231371,
"volume_molar": 19.18694214151937,
"formula_full": "K8 Mn2 Br12",
"formula_reduced": "K4MnBr6",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.0,
"spacegroup": 167
},
{
"id": "jvasp-40223",
"created_at": "2022-09-04T14:37:41.747884Z",
"updated_at": "2022-09-04T14:37:41.747909Z",
"structure_string": "Sc1 Zn2 Ag1\n1.0\n0.000000 3.224546 3.224546\n3.224546 -0.000000 3.224546\n3.224546 3.224546 0.000000\nSc Zn Ag\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Sc\n0.000000 0.000000 0.000000 Zn\n0.500002 0.500002 0.500002 Zn\n0.249999 0.249999 0.249999 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Zn",
"Ag"
],
"chemical_system": "Ag-Sc-Zn",
"density": 7.023993191703336,
"density_atomic": 0.05965189782867919,
"volume": 67.05570393565746,
"volume_molar": 10.095472196535379,
"formula_full": "Sc1 Zn2 Ag1",
"formula_reduced": "ScZn2Ag",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-40883",
"created_at": "2022-09-04T14:37:43.918804Z",
"updated_at": "2022-09-04T14:37:43.918824Z",
"structure_string": "Pm1 Zn2 Ag1\n1.0\n-0.000000 3.398740 3.398739\n3.398741 0.000000 3.398738\n3.398741 3.398739 0.000001\nPm Zn Ag\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Pm\n0.000000 0.000000 0.000000 Zn\n0.499999 0.499999 0.499999 Zn\n0.249999 0.249999 0.249999 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Zn",
"Ag"
],
"chemical_system": "Ag-Pm-Zn",
"density": 8.114124075902563,
"density_atomic": 0.05094204310301142,
"volume": 78.5206041287249,
"volume_molar": 11.821553265585463,
"formula_full": "Pm1 Zn2 Ag1",
"formula_reduced": "PmZn2Ag",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-41739",
"created_at": "2022-09-04T14:37:41.883954Z",
"updated_at": "2022-09-04T14:37:41.883980Z",
"structure_string": "Cd2 Ag1 Rh1\n1.0\n-0.000002 3.287063 3.287065\n3.287065 -0.000003 3.287067\n3.287066 3.287066 -0.000004\nCd Ag Rh\n2 1 1\ndirect\n0.500000 0.500001 0.500000 Cd\n0.000000 0.000000 0.000000 Cd\n0.250000 0.250001 0.250000 Ag\n0.750000 0.750002 0.750000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cd",
"Ag",
"Rh"
],
"chemical_system": "Ag-Cd-Rh",
"density": 10.183031395167163,
"density_atomic": 0.05631244610209695,
"volume": 71.03225444598559,
"volume_molar": 10.694155869346526,
"formula_full": "Cd2 Ag1 Rh1",
"formula_reduced": "Cd2AgRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-40528",
"created_at": "2022-09-04T14:37:53.320092Z",
"updated_at": "2022-09-04T14:37:53.320124Z",
"structure_string": "Li1 Ca2 Ga1\n1.0\n0.000000 3.708005 3.708005\n3.708005 -0.000000 3.708005\n3.708005 3.708005 0.000000\nLi Ca Ga\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Li\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.250001 0.250001 0.250001 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ca",
"Ga"
],
"chemical_system": "Ca-Ga-Li",
"density": 2.553874889716771,
"density_atomic": 0.03922916483769621,
"volume": 101.9649543024762,
"volume_molar": 15.351182684911983,
"formula_full": "Li1 Ca2 Ga1",
"formula_reduced": "LiCa2Ga",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-21683",
"created_at": "2022-09-04T14:37:34.249491Z",
"updated_at": "2022-09-04T14:37:34.249518Z",
"structure_string": "Tb4 F12\n1.0\n4.379917 0.000000 0.000000\n-0.000000 6.473404 0.000000\n0.000000 0.000000 6.921688\nTb F\n4 12\ndirect\n0.935309 0.630713 0.750000 Tb\n0.435309 0.869286 0.250000 Tb\n0.564691 0.130713 0.750000 Tb\n0.064691 0.369287 0.250000 Tb\n0.384088 0.165721 0.436942 F\n0.884089 0.334278 0.563059 F\n0.115912 0.665721 0.063059 F\n0.615912 0.834278 0.936942 F\n0.583212 0.520815 0.250000 F\n0.083211 0.979184 0.750000 F\n0.916789 0.020815 0.250000 F\n0.416789 0.479185 0.750000 F\n0.384088 0.165721 0.063059 F\n0.884089 0.334278 0.936942 F\n0.115912 0.665721 0.436942 F\n0.615912 0.834278 0.563059 F\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Tb",
"F"
],
"chemical_system": "F-Tb",
"density": 7.307897951116305,
"density_atomic": 0.08152848476879665,
"volume": 196.25042763119853,
"volume_molar": 7.386548121282944,
"formula_full": "Tb4 F12",
"formula_reduced": "TbF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-34769",
"created_at": "2022-09-04T14:37:53.241723Z",
"updated_at": "2022-09-04T14:37:53.241745Z",
"structure_string": "Ba4 Cl8\n1.0\n4.733923 -0.000000 0.000000\n-0.000000 7.875217 0.000000\n0.000000 0.000000 9.497074\nBa Cl\n4 8\ndirect\n0.250000 0.748613 0.619052 Ba\n0.750000 0.251388 0.380947 Ba\n0.250000 0.248612 0.880947 Ba\n0.750000 0.751388 0.119052 Ba\n0.250000 0.530433 0.328487 Cl\n0.750000 0.469567 0.671513 Cl\n0.250000 0.030433 0.171513 Cl\n0.750000 0.969567 0.828486 Cl\n0.750000 0.856353 0.430796 Cl\n0.250000 0.143648 0.569203 Cl\n0.750000 0.356353 0.069203 Cl\n0.250000 0.643648 0.930796 Cl\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ba",
"Cl"
],
"chemical_system": "Ba-Cl",
"density": 3.906475489124365,
"density_atomic": 0.03389281998404666,
"volume": 354.05729017675117,
"volume_molar": 17.76819032123801,
"formula_full": "Ba4 Cl8",
"formula_reduced": "BaCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-20222",
"created_at": "2022-09-04T14:37:46.851933Z",
"updated_at": "2022-09-04T14:37:46.851961Z",
"structure_string": "Ca1 Cu5\n1.0\n2.551505 -4.419335 0.000000\n2.551505 4.419335 -0.000000\n0.000000 0.000000 4.067150\nCa Cu\n1 5\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333332 0.666666 0.000000 Cu\n0.666666 0.333332 0.000000 Cu\n0.500000 -0.000001 0.500000 Cu\n0.499999 0.499999 0.500000 Cu\n-0.000001 0.500000 0.500000 Cu\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"Cu"
],
"chemical_system": "Ca-Cu",
"density": 6.477771298519466,
"density_atomic": 0.0654150559812859,
"volume": 91.72200359679421,
"volume_molar": 9.206046940818684,
"formula_full": "Ca1 Cu5",
"formula_reduced": "CaCu5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 191
},
{
"id": "jvasp-40288",
"created_at": "2022-09-04T14:37:47.046421Z",
"updated_at": "2022-09-04T14:37:47.046432Z",
"structure_string": "Sr1 Cd1 Hg2\n1.0\n-0.000000 3.761821 3.761821\n3.761821 -0.000000 3.761821\n3.761821 3.761821 -0.000000\nSr Cd Hg\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Sr\n0.249999 0.249999 0.249999 Cd\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg-Sr",
"density": 9.376734953491317,
"density_atomic": 0.03756951737652898,
"volume": 106.46929423956198,
"volume_molar": 16.029326913212486,
"formula_full": "Sr1 Cd1 Hg2",
"formula_reduced": "SrCdHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}